2-(2-methyl-5-nitro-imidazol-1-yl)ethylsulfanylcarbamic acid

Systemtic Name: 2-(2-methyl-5-nitro-imidazol-1-yl)ethylsulfanylcarbamic acid Openeye Name: 2-(2-methyl-5-nitro-imidazol-1-yl)ethylsulfanylcarbamic acid CAS Name: [2-(2-methyl-5-nitro-1-imidazolyl)ethylthio]carbamic acid IUPAC Name: 2-(2-methyl-5-nitroimidazol-1-yl)ethylsulfanylcarbamic acid Traditional Name: [2-(2-methyl-5-nitro-imidazol-1-yl)ethylthio]carbamic acid Formula: C7H10N4O4S MolecularWeight: 246.2437

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N1CCSNC(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC1=NC=C(N1CCSNC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C7H10N4O4S/c1-5-8-4-6(11(14)15)10(5)2-3-16-9-7(12)13/h4,9H,2-3H2,1H3,(H,12,13)